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ID of heme Axial ligands on heme Function & structure
3t3q-A-500
sad. -0.14
ruf. -0.29
dom. +0.14
bre. -0.29
CYS chainID: A,
resSeq: 439,
molecule: Cytochrome P450 2A6
oxidoreductase
oligomeric count: 1
pocket vol.: 413.0 Å3
d(Fe-oop): 0.088 Å
9PL chainID: A, resSeq: 501,

molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one

3t3q-B-500
sad. -0.14
ruf. -0.10
dom. +0.07
bre. -0.32
CYS chainID: B,
resSeq: 439,
molecule: Cytochrome P450 2A6
oxidoreductase
oligomeric count: 1
pocket vol.: 415.0 Å3
d(Fe-oop): 0.091 Å
9PL chainID: B, resSeq: 501,

molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one

3t3q-C-500
sad. -0.05
ruf. -0.25
dom. +0.02
bre. -0.19
CYS chainID: C,
resSeq: 439,
molecule: Cytochrome P450 2A6
oxidoreductase
oligomeric count: 1
pocket vol.: 422.0 Å3
d(Fe-oop): 0.005 Å
9PL chainID: C, resSeq: 501,

molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one

3t3q-D-500
sad. -0.03
ruf. -0.28
dom. -0.01
bre. -0.31
CYS chainID: D,
resSeq: 439,
molecule: Cytochrome P450 2A6
oxidoreductase
oligomeric count: 1
pocket vol.: 412.0 Å3
d(Fe-oop): 0.075 Å
9PL chainID: D, resSeq: 501,

molecule: (3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one